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7-(phenylmethyl)-2-[3-(trifluoromethyl)phenyl]-3H-purin-6-one

7-(phenylmethyl)-2-[3-(trifluoromethyl)phenyl]-3H-purin-6-one

Systemtic Name:7-(phenylmethyl)-2-[3-(trifluoromethyl)phenyl]-3H-purin-6-one
Openeye Name:7-benzyl-2-[3-(trifluoromethyl)phenyl]-3H-purin-6-one
CAS Name:7-(phenylmethyl)-2-[3-(trifluoromethyl)phenyl]-3H-purin-6-one
IUPAC Name:7-benzyl-2-[3-(trifluoromethyl)phenyl]-3H-purin-6-one
Traditional Name:7-benzyl-2-[3-(trifluoromethyl)phenyl]-3H-purin-6-one
Formula: C19H13F3N4O
MolecularWeight: 370.32793
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC=C4)C(F)(F)F


Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC=C4)C(F)(F)F


InChI

InChI=1S/C19H13F3N4O/c20-19(21,22)14-8-4-7-13(9-14)16-24-17-15(18(27)25-16)26(11-23-17)10-12-5-2-1-3-6-12/h1-9,11H,10H2,(H,24,25,27)


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